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CUDAKernels.h File Reference

#include "WKFThreads.h"

Go to the source code of this file.

Defines

#define VMDCUDA_ERR_NONE   0

#define VMDCUDA_ERR_GENERAL   -1

#define VMDCUDA_ERR_NODEVICES   -2

#define VMDCUDA_ERR_SOMEDEVICES   -3

#define VMDCUDA_ERR_DRVMISMATCH   -4

#define VMDCUDA_ERR_EMUDEVICE   -5

#define VMDCUDA_COMPUTEMODE_DEFAULT   0

#define VMDCUDA_COMPUTEMODE_EXCLUSIVE   1

#define VMDCUDA_COMPUTEMODE_PROHIBITED   2

Functions

int vmd_cuda_num_devices (int *numdev)

int vmd_cuda_device_props (int dev, char *name, int namelen, int *revmajor, int *revminor, unsigned long *memb, int *clockratekhz, int *smcount, int *overlap, int *kerneltimeout, int *canmaphostmem, int *computemode)

void * vmd_cuda_devpool_setdevice (void *voidparms)

void * vmd_cuda_devpool_clear_device_mem (void *)

int vmd_cuda_madd_gflops (int numdevs, int *devlist, double *gflops, int testloops)

int vmd_cuda_bus_bw (int numdevs, int *devlist, double *hdmbsec, double *hdlatusec, double *phdmbsec, double *phdlatusec, double *dhmbsec, double *dhlatusec, double *pdhmbsec, double *pdhlatusec)

int vmd_cuda_globmem_bw (int numdevs, int *devlist, double *memsetgbsec, double *memcpygbsec)

int vmd_cuda_devpool_latency (wkf_threadpool_t *devpool, int tilesize, double *kernlaunchlatency, double *barlatency, double *cyclelatency, double *tilelatency, double *kernellatency)

int vmd_cuda_measure_latencies (wkf_threadpool_t *devpool)

int vmd_cuda_vol_cpotential (long int natoms, float *atoms, float *grideners, long int numplane, long int numcol, long int numpt, float gridspacing)

int vmd_cuda_quicksurf (long int natoms, const float *xyzr, const float *colors, int colorperatom, float *origin, int *numvoxels, float maxrad, float radscale, float gridspacing, float isovalue, float gausslim, int &numverts, float *&v, float *&n, float *&c, int &numfacets, int *&f)

int vmd_cuda_evaluate_orbital_grid (wkf_threadpool_t *devpool, int numatoms, const float *wave_f, int num_wave_f, const float *basis_array, int num_basis, const float *atompos, const int *atom_basis, const int *num_shells_per_atom, const int *num_prim_per_shell, const int *shell_types, int num_shells, const int *numvoxels, float voxelsize, const float *origin, int density, float *orbitalgrid)

int vmd_cuda_evaluate_occupancy_map (int mx, int my, int mz, float *map, float max_energy, float cutoff, float hx, float hy, float hz, float x0, float y0, float z0, float bx_1, float by_1, float bz_1, int nbx, int nby, int nbz, const float *bin, const float *bin_zero, int num_binoffsets, const char *binoffsets, int num_extras, const float *extra, int num_vdwparms, const float *vdwparms, int num_probes, const float *probevdwparms, int num_conformers, const float *conformers)

int rdf_gpu (wkf_threadpool_t *devpool, int usepbc, int natoms1, float *xyz, int natoms2, float *xyz2, float *cell, float *hist, int maxbin, float rmin, float delr)

Define Documentation

#define VMDCUDA_COMPUTEMODE_DEFAULT 0

Definition at line 45 of file CUDAKernels.h.
Referenced by vmd_cuda_device_props.

#define VMDCUDA_COMPUTEMODE_EXCLUSIVE 1

Definition at line 46 of file CUDAKernels.h.

#define VMDCUDA_COMPUTEMODE_PROHIBITED 2

Definition at line 47 of file CUDAKernels.h.

#define VMDCUDA_ERR_DRVMISMATCH -4

Definition at line 40 of file CUDAKernels.h.
Referenced by CUDAAccel::CUDAAccel, vmd_cuda_drv_runtime_compatible, and vmd_cuda_num_devices.

#define VMDCUDA_ERR_EMUDEVICE -5

Definition at line 41 of file CUDAKernels.h.
Referenced by vmd_cuda_device_props, and vmd_cuda_num_devices.

#define VMDCUDA_ERR_GENERAL -1

Definition at line 37 of file CUDAKernels.h.
Referenced by vmd_cuda_device_props.

#define VMDCUDA_ERR_NODEVICES -2

Definition at line 38 of file CUDAKernels.h.
Referenced by CUDAAccel::CUDAAccel, vmd_cuda_drv_runtime_compatible, and vmd_cuda_num_devices.

#define VMDCUDA_ERR_NONE 0

Definition at line 36 of file CUDAKernels.h.
Referenced by cuda_occupancy_thread, CUDAAccel::CUDAAccel, vmd_cuda_device_props, vmd_cuda_drv_runtime_compatible, and vmd_cuda_num_devices.

#define VMDCUDA_ERR_SOMEDEVICES -3

Definition at line 39 of file CUDAKernels.h.
Referenced by CUDAAccel::CUDAAccel, and vmd_cuda_num_devices.

Function Documentation

int rdf_gpu ( wkf_threadpool_t * devpool,

int usepbc,

int natoms1,

float * xyz,

int natoms2,

float * xyz2,

float * cell,

float * hist,

int maxbin,

float rmin,

float delr

)

Definition at line 904 of file CUDAMeasureRDF.cu.

int vmd_cuda_bus_bw ( int numdevs,

int * devlist,

double * hdmbsec,

double * hdlatusec,

double * phdmbsec,

double * phdlatusec,

double * dhmbsec,

double * dhlatusec,

double * pdhmbsec,

double * pdhlatusec

)

Definition at line 425 of file CUDABench.cu.
Referenced by text_cmd_vmdbench.

int vmd_cuda_device_props ( int dev,

char * name,

int namelen,

int * revmajor,

int * revminor,

unsigned long * memb,

int * clockratekhz,

int * smcount,

int * overlap,

int * kerneltimeout,

int * canmaphostmem,

int * computemode

)

Definition at line 54 of file CUDAUtil.cu.

void* vmd_cuda_devpool_clear_device_mem ( void * )

Definition at line 42 of file CUDAClearDevice.cu.

int vmd_cuda_devpool_latency ( wkf_threadpool_t * devpool,

int tilesize,

double * kernlaunchlatency,

double * barlatency,

double * cyclelatency,

double * tilelatency,

double * kernellatency

)

Definition at line 731 of file CUDABench.cu.
Referenced by text_cmd_vmdbench.

void* vmd_cuda_devpool_setdevice ( void * voidparms )

Definition at line 163 of file CUDAUtil.cu.

int vmd_cuda_evaluate_occupancy_map ( int mx,

int my,

int mz,

float * map,

float max_energy,

float cutoff,

float hx,

float hy,

float hz,

float x0,

float y0,

float z0,

float bx_1,

float by_1,

float bz_1,

int nbx,

int nby,

int nbz,

const float * bin,

const float * bin_zero,

int num_binoffsets,

const char * binoffsets,

int num_extras,

const float * extra,

int num_vdwparms,

const float * vdwparms,

int num_probes,

const float * probevdwparms,

int num_conformers,

const float * conformers

)

Definition at line 1615 of file CUDAVolMapCreateILS.cu.

int vmd_cuda_evaluate_orbital_grid ( wkf_threadpool_t * devpool,

int numatoms,

const float * wave_f,

int num_wave_f,

const float * basis_array,

int num_basis,

const float * atompos,

const int * atom_basis,

const int * num_shells_per_atom,

const int * num_prim_per_shell,

const int * shell_types,

int num_shells,

const int * numvoxels,

float voxelsize,

const float * origin,

int density,

float * orbitalgrid

)

Definition at line 954 of file CUDAOrbital.cu.

int vmd_cuda_globmem_bw ( int numdevs,

int * devlist,

double * memsetgbsec,

double * memcpygbsec

)

Definition at line 610 of file CUDABench.cu.
Referenced by text_cmd_vmdbench.

int vmd_cuda_madd_gflops ( int numdevs,

int * devlist,

double * gflops,

int testloops

)

Definition at line 189 of file CUDABench.cu.
Referenced by text_cmd_vmdbench.

int vmd_cuda_measure_latencies ( wkf_threadpool_t * devpool )

Definition at line 879 of file CUDABench.cu.
Referenced by vmd_cuda_devpool_latency.

int vmd_cuda_num_devices ( int * numdev )

Definition at line 118 of file CUDAUtil.cu.

int vmd_cuda_quicksurf ( long int natoms,

const float * xyzr,

const float * colors,

int colorperatom,

float * origin,

int * numvoxels,

float maxrad,

float radscale,

float gridspacing,

float isovalue,

float gausslim,

int & numverts,

float *& v,

float *& n,

float *& c,

int & numfacets,

int *& f

)

int vmd_cuda_vol_cpotential ( long int natoms,

float * atoms,

float * grideners,

long int numplane,

long int numcol,

long int numpt,

float gridspacing

)

Definition at line 222 of file CUDAVolCPotential.cu.

Generated on Wed May 16 01:50:02 2012 for VMD (current) by

Defines
#define	VMDCUDA_ERR_NONE 0
#define	VMDCUDA_ERR_GENERAL -1
#define	VMDCUDA_ERR_NODEVICES -2
#define	VMDCUDA_ERR_SOMEDEVICES -3
#define	VMDCUDA_ERR_DRVMISMATCH -4
#define	VMDCUDA_ERR_EMUDEVICE -5
#define	VMDCUDA_COMPUTEMODE_DEFAULT 0
#define	VMDCUDA_COMPUTEMODE_EXCLUSIVE 1
#define	VMDCUDA_COMPUTEMODE_PROHIBITED 2
Functions
int	vmd_cuda_num_devices (int *numdev)
int	vmd_cuda_device_props (int dev, char name, int namelen, int revmajor, int revminor, unsigned long memb, int clockratekhz, int smcount, int overlap, int kerneltimeout, int canmaphostmem, int computemode)
void *	vmd_cuda_devpool_setdevice (void *voidparms)
void *	vmd_cuda_devpool_clear_device_mem (void *)
int	vmd_cuda_madd_gflops (int numdevs, int devlist, double gflops, int testloops)
int	vmd_cuda_bus_bw (int numdevs, int devlist, double hdmbsec, double hdlatusec, double phdmbsec, double phdlatusec, double dhmbsec, double dhlatusec, double pdhmbsec, double *pdhlatusec)
int	vmd_cuda_globmem_bw (int numdevs, int devlist, double memsetgbsec, double *memcpygbsec)
int	vmd_cuda_devpool_latency (wkf_threadpool_t devpool, int tilesize, double kernlaunchlatency, double barlatency, double cyclelatency, double tilelatency, double kernellatency)
int	vmd_cuda_measure_latencies (wkf_threadpool_t *devpool)
int	vmd_cuda_vol_cpotential (long int natoms, float atoms, float grideners, long int numplane, long int numcol, long int numpt, float gridspacing)
int	vmd_cuda_quicksurf (long int natoms, const float xyzr, const float colors, int colorperatom, float origin, int numvoxels, float maxrad, float radscale, float gridspacing, float isovalue, float gausslim, int &numverts, float &v, float &n, float &c, int &numfacets, int &f)
int	vmd_cuda_evaluate_orbital_grid (wkf_threadpool_t devpool, int numatoms, const float wave_f, int num_wave_f, const float basis_array, int num_basis, const float atompos, const int atom_basis, const int num_shells_per_atom, const int num_prim_per_shell, const int shell_types, int num_shells, const int numvoxels, float voxelsize, const float origin, int density, float *orbitalgrid)
int	vmd_cuda_evaluate_occupancy_map (int mx, int my, int mz, float map, float max_energy, float cutoff, float hx, float hy, float hz, float x0, float y0, float z0, float bx_1, float by_1, float bz_1, int nbx, int nby, int nbz, const float bin, const float bin_zero, int num_binoffsets, const char binoffsets, int num_extras, const float extra, int num_vdwparms, const float vdwparms, int num_probes, const float probevdwparms, int num_conformers, const float conformers)
int	rdf_gpu (wkf_threadpool_t devpool, int usepbc, int natoms1, float xyz, int natoms2, float xyz2, float cell, float *hist, int maxbin, float rmin, float delr)